[5-bromanyl-2-[(4-methylphenyl)methoxy]phenyl]methyl-butyl-azanium

Systemtic Name: [5-bromanyl-2-[(4-methylphenyl)methoxy]phenyl]methyl-butyl-azanium Openeye Name: [5-bromo-2-(p-tolylmethoxy)phenyl]methyl-butyl-ammonium CAS Name: [5-bromo-2-[(4-methylphenyl)methoxy]phenyl]methyl-butylammonium IUPAC Name: [5-bromo-2-[(4-methylphenyl)methoxy]phenyl]methyl-butylazanium Traditional Name: [5-bromo-2-(4-methylbenzyl)oxy-benzyl]-butyl-ammonium Formula: C19H25BrNO+ MolecularWeight: 363.3119

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]CC1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)C

Isomeric SMILES

CCCC[NH2+]CC1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)C

InChI

InChI=1S/C19H24BrNO/c1-3-4-11-21-13-17-12-18(20)9-10-19(17)22-14-16-7-5-15(2)6-8-16/h5-10,12,21H,3-4,11,13-14H2,1-2H3/p+1